(2-methoxy-5-nitro-phenyl)methyl 3-(2,3-dihydroindol-1-ylsulfonyl)benzoate

Systemtic Name: (2-methoxy-5-nitro-phenyl)methyl 3-(2,3-dihydroindol-1-ylsulfonyl)benzoate Openeye Name: (2-methoxy-5-nitro-phenyl)methyl 3-indolin-1-ylsulfonylbenzoate CAS Name: 3-(2,3-dihydroindol-1-ylsulfonyl)benzoic acid (2-methoxy-5-nitrophenyl)methyl ester IUPAC Name: (2-methoxy-5-nitrophenyl)methyl 3-(2,3-dihydroindol-1-ylsulfonyl)benzoate Traditional Name: 3-indolin-1-ylsulfonylbenzoic acid (2-methoxy-5-nitro-benzyl) ester Formula: C23H20N2O7S MolecularWeight: 468.4791

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])COC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCC4=CC=CC=C43

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])COC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCC4=CC=CC=C43

InChI

InChI=1S/C23H20N2O7S/c1-31-22-10-9-19(25(27)28)13-18(22)15-32-23(26)17-6-4-7-20(14-17)33(29,30)24-12-11-16-5-2-3-8-21(16)24/h2-10,13-14H,11-12,15H2,1H3